N-[3-(1H-indol-3-yl)-1-(5-methylhexan-2-ylamino)-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-(1H-indol-3-yl)-1-(5-methylhexan-2-ylamino)-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-(1,4-dimethylpentylamino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[3-(1H-indol-3-yl)-1-(5-methylhexan-2-ylamino)-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-(1H-indol-3-yl)-1-(5-methylhexan-2-ylamino)-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-(1,4-dimethylpentylamino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]thiophene-2-carboxamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)CCC(C)NC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC=CS3

InChI

InChI=1S/C23H29N3O2S/c1-15(2)10-11-16(3)25-22(27)20(26-23(28)21-9-6-12-29-21)13-17-14-24-19-8-5-4-7-18(17)19/h4-9,12,14-16,20,24H,10-11,13H2,1-3H3,(H,25,27)(H,26,28)