5-(2-diethylaminoethyl)-2-[(Z)-[5-fluoranyl-6-[(4-fluorophenyl)methylamino]-2-oxidanylidene-1H-indol-3-ylidene]methyl]-3-methyl-1,6,7,8-tetrahydropyrrolo[3,2-c]azepin-4-one

Systemtic Name: 5-(2-diethylaminoethyl)-2-[(Z)-[5-fluoranyl-6-[(4-fluorophenyl)methylamino]-2-oxidanylidene-1H-indol-3-ylidene]methyl]-3-methyl-1,6,7,8-tetrahydropyrrolo[3,2-c]azepin-4-one Openeye Name: 5-(2-diethylaminoethyl)-2-[(Z)-[5-fluoro-6-[(4-fluorophenyl)methylamino]-2-oxo-indolin-3-ylidene]methyl]-3-methyl-1,6,7,8-tetrahydropyrrolo[3,2-c]azepin-4-one CAS Name: 5-(2-diethylaminoethyl)-2-[(Z)-[5-fluoro-6-[(4-fluorophenyl)methylamino]-2-oxo-1H-indol-3-ylidene]methyl]-3-methyl-1,6,7,8-tetrahydropyrrolo[3,2-c]azepin-4-one IUPAC Name: 5-(2-diethylaminoethyl)-2-[(Z)-[5-fluoro-6-[(4-fluorophenyl)methylamino]-2-oxo-1H-indol-3-ylidene]methyl]-3-methyl-1,6,7,8-tetrahydropyrrolo[3,2-c]azepin-4-one Traditional Name: 5-(2-diethylaminoethyl)-2-[(Z)-[5-fluoro-6-[(4-fluorobenzyl)amino]-2-keto-indolin-3-ylidene]methyl]-3-methyl-1,6,7,8-tetrahydropyrrol[3,2-c]azepin-4-one Formula: C31H35F2N5O2 MolecularWeight: 547.638706

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1CCCC2=C(C1=O)C(=C(N2)C=C3C4=CC(=C(C=C4NC3=O)NCC5=CC=C(C=C5)F)F)C

Isomeric SMILES

CCN(CC)CCN1CCCC2=C(C1=O)C(=C(N2)/C=C\3/C4=CC(=C(C=C4NC3=O)NCC5=CC=C(C=C5)F)F)C

InChI

InChI=1S/C31H35F2N5O2/c1-4-37(5-2)13-14-38-12-6-7-25-29(31(38)40)19(3)26(35-25)16-23-22-15-24(33)28(17-27(22)36-30(23)39)34-18-20-8-10-21(32)11-9-20/h8-11,15-17,34-35H,4-7,12-14,18H2,1-3H3,(H,36,39)/b23-16-