N-[3-(1H-indol-3-yl)-1-(6-methylheptan-2-ylamino)-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-(1H-indol-3-yl)-1-(6-methylheptan-2-ylamino)-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-(1,5-dimethylhexylamino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[3-(1H-indol-3-yl)-1-(6-methylheptan-2-ylamino)-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-(1H-indol-3-yl)-1-(6-methylheptan-2-ylamino)-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-(1,5-dimethylhexylamino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]thiophene-2-carboxamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O2S/c1-16(2)8-6-9-17(3)26-23(28)21(27-24(29)22-12-7-13-30-22)14-18-15-25-20-11-5-4-10-19(18)20/h4-5,7,10-13,15-17,21,25H,6,8-9,14H2,1-3H3,(H,26,28)(H,27,29)