2-[2-[(4-methoxy-2-methyl-phenyl)carbamothioylamino]ethanoylamino]-4-methyl-pentanamide

Systemtic Name: 2-[2-[(4-methoxy-2-methyl-phenyl)carbamothioylamino]ethanoylamino]-4-methyl-pentanamide Openeye Name: 2-[[2-[(4-methoxy-2-methyl-phenyl)carbamothioylamino]acetyl]amino]-4-methyl-pentanamide CAS Name: 2-[[2-[[(4-methoxy-2-methylanilino)-sulfanylidenemethyl]amino]-1-oxoethyl]amino]-4-methylpentanamide IUPAC Name: 2-[[2-[(4-methoxy-2-methylphenyl)carbamothioylamino]acetyl]amino]-4-methylpentanamide Traditional Name: 2-[[2-[(4-methoxy-2-methyl-phenyl)thiocarbamoylamino]acetyl]amino]-4-methyl-valeramide Formula: C17H26N4O3S MolecularWeight: 366.47834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)NC(=S)NCC(=O)NC(CC(C)C)C(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)OC)NC(=S)NCC(=O)NC(CC(C)C)C(=O)N

InChI

InChI=1S/C17H26N4O3S/c1-10(2)7-14(16(18)23)20-15(22)9-19-17(25)21-13-6-5-12(24-4)8-11(13)3/h5-6,8,10,14H,7,9H2,1-4H3,(H2,18,23)(H,20,22)(H2,19,21,25)