methyl N-[[4-cyclopentylsulfanyl-2-[2-(dimethylamino)ethanoylamino]phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[4-cyclopentylsulfanyl-2-[2-(dimethylamino)ethanoylamino]phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[4-cyclopentylsulfanyl-2-[[2-(dimethylamino)acetyl]amino]phenyl]carbamothioyl]carbamate CAS Name: N-[[4-(cyclopentylthio)-2-[[2-(dimethylamino)-1-oxoethyl]amino]anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[4-cyclopentylsulfanyl-2-[[2-(dimethylamino)acetyl]amino]phenyl]carbamothioyl]carbamate Traditional Name: N-[[4-(cyclopentylthio)-2-[[2-(dimethylamino)acetyl]amino]phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C18H26N4O3S2 MolecularWeight: 410.55404

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(=O)NC1=C(C=CC(=C1)SC2CCCC2)NC(=S)NC(=O)OC

Isomeric SMILES

CN(C)CC(=O)NC1=C(C=CC(=C1)SC2CCCC2)NC(=S)NC(=O)OC

InChI

InChI=1S/C18H26N4O3S2/c1-22(2)11-16(23)19-15-10-13(27-12-6-4-5-7-12)8-9-14(15)20-17(26)21-18(24)25-3/h8-10,12H,4-7,11H2,1-3H3,(H,19,23)(H2,20,21,24,26)