N-(2-methylpropyl)-1-[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]carbamoyl]piperidine-4-carboxamide

Systemtic Name: N-(2-methylpropyl)-1-[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]carbamoyl]piperidine-4-carboxamide Openeye Name: N-isobutyl-1-[[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]carbamoyl]piperidine-4-carboxamide CAS Name: N-(2-methylpropyl)-1-[[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(2-methylpropyl)-1-[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)amino]carbamoyl]piperidine-4-carboxamide Traditional Name: N-isobutyl-1-[[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]carbamoyl]isonipecotamide Formula: C21H32N4O3S MolecularWeight: 420.56878

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)N3CCC(CC3)C(=O)NCC(C)C

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)N3CCC(CC3)C(=O)NCC(C)C

InChI

InChI=1S/C21H32N4O3S/c1-13(2)12-22-19(26)15-6-8-25(9-7-15)21(28)24-23-20(27)18-11-16-10-14(3)4-5-17(16)29-18/h11,13-15H,4-10,12H2,1-3H3,(H,22,26)(H,23,27)(H,24,28)