methyl 1-[2-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methylamino]-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methylamino]-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-[(5-morpholinosulfonyl-2-thienyl)methylamino]-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-[[5-(4-morpholinylsulfonyl)-2-thiophenyl]methylamino]-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methylamino]-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-keto-2-[(5-morpholinosulfonyl-2-thienyl)methylamino]ethyl]indole-3-carboxylic acid methyl ester Formula: C21H23N3O6S2 MolecularWeight: 477.55382

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H23N3O6S2/c1-29-21(26)17-13-23(18-5-3-2-4-16(17)18)14-19(25)22-12-15-6-7-20(31-15)32(27,28)24-8-10-30-11-9-24/h2-7,13H,8-12,14H2,1H3,(H,22,25)