1-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]-3-(2-thiophen-2-ylethyl)thiourea

Systemtic Name: 1-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]-3-(2-thiophen-2-ylethyl)thiourea Openeye Name: 1-[[4-methyl-2-(p-tolylsulfonylamino)pentanoyl]amino]-3-[2-(2-thienyl)ethyl]thiourea CAS Name: 1-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxopentyl]amino]-3-(2-thiophen-2-ylethyl)thiourea IUPAC Name: 1-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]-3-(2-thiophen-2-ylethyl)thiourea Traditional Name: 1-[[4-methyl-2-(tosylamino)pentanoyl]amino]-3-[2-(2-thienyl)ethyl]thiourea Formula: C20H28N4O3S3 MolecularWeight: 468.65632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)NNC(=S)NCCC2=CC=CS2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)NNC(=S)NCCC2=CC=CS2

InChI

InChI=1S/C20H28N4O3S3/c1-14(2)13-18(24-30(26,27)17-8-6-15(3)7-9-17)19(25)22-23-20(28)21-11-10-16-5-4-12-29-16/h4-9,12,14,18,24H,10-11,13H2,1-3H3,(H,22,25)(H2,21,23,28)