1-[(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]-3-(2-methylphenyl)thiourea

Systemtic Name: 1-[(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]-3-(2-methylphenyl)thiourea Openeye Name: 1-[(2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoyl)amino]-3-(o-tolyl)thiourea CAS Name: 1-[[[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]-3-(2-methylphenyl)thiourea IUPAC Name: 1-[(2-chloro-5-pyrrolidin-1-ylsulfonylbenzoyl)amino]-3-(2-methylphenyl)thiourea Traditional Name: 1-[(2-chloro-5-pyrrolidinosulfonyl-benzoyl)amino]-3-(o-tolyl)thiourea Formula: C19H21ClN4O3S2 MolecularWeight: 452.97804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

InChI

InChI=1S/C19H21ClN4O3S2/c1-13-6-2-3-7-17(13)21-19(28)23-22-18(25)15-12-14(8-9-16(15)20)29(26,27)24-10-4-5-11-24/h2-3,6-9,12H,4-5,10-11H2,1H3,(H,22,25)(H2,21,23,28)