2-[[4-(2-morpholin-4-yl-4-oxidanylidene-chromen-8-yl)dibenzothiophen-1-yl]methylamino]ethanenitrile

Systemtic Name: 2-[[4-(2-morpholin-4-yl-4-oxidanylidene-chromen-8-yl)dibenzothiophen-1-yl]methylamino]ethanenitrile Openeye Name: 2-[[4-(2-morpholino-4-oxo-chromen-8-yl)dibenzothiophen-1-yl]methylamino]acetonitrile CAS Name: 2-[[4-[2-(4-morpholinyl)-4-oxo-1-benzopyran-8-yl]-1-dibenzothiophenyl]methylamino]acetonitrile IUPAC Name: 2-[[4-(2-morpholin-4-yl-4-oxochromen-8-yl)dibenzothiophen-1-yl]methylamino]acetonitrile Traditional Name: 2-[[4-(4-keto-2-morpholino-chromen-8-yl)dibenzothiophen-1-yl]methylamino]acetonitrile Formula: C28H23N3O3S MolecularWeight: 481.56552

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=O)C3=C(O2)C(=CC=C3)C4=C5C(=C(C=C4)CNCC#N)C6=CC=CC=C6S5

Isomeric SMILES

C1COCCN1C2=CC(=O)C3=C(O2)C(=CC=C3)C4=C5C(=C(C=C4)CNCC#N)C6=CC=CC=C6S5

InChI

InChI=1S/C28H23N3O3S/c29-10-11-30-17-18-8-9-20(28-26(18)22-4-1-2-7-24(22)35-28)19-5-3-6-21-23(32)16-25(34-27(19)21)31-12-14-33-15-13-31/h1-9,16,30H,11-15,17H2