methyl 2-[[[5-methyl-4-(4-methylphenyl)thiophen-3-yl]carbonylamino]carbamoylamino]benzoate

Systemtic Name: methyl 2-[[[5-methyl-4-(4-methylphenyl)thiophen-3-yl]carbonylamino]carbamoylamino]benzoate Openeye Name: methyl 2-[[[5-methyl-4-(p-tolyl)thiophene-3-carbonyl]amino]carbamoylamino]benzoate CAS Name: 2-[[[[[5-methyl-4-(4-methylphenyl)-3-thiophenyl]-oxomethyl]hydrazo]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[[5-methyl-4-(4-methylphenyl)thiophene-3-carbonyl]amino]carbamoylamino]benzoate Traditional Name: 2-[[[5-methyl-4-(p-tolyl)thiophene-3-carbonyl]amino]carbamoylamino]benzoic acid methyl ester Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC=C2C(=O)NNC(=O)NC3=CC=CC=C3C(=O)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC=C2C(=O)NNC(=O)NC3=CC=CC=C3C(=O)OC)C

InChI

InChI=1S/C22H21N3O4S/c1-13-8-10-15(11-9-13)19-14(2)30-12-17(19)20(26)24-25-22(28)23-18-7-5-4-6-16(18)21(27)29-3/h4-12H,1-3H3,(H,24,26)(H2,23,25,28)