1-[2-(3-methylphenyl)ethyl]-3-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]thiourea

Systemtic Name: 1-[2-(3-methylphenyl)ethyl]-3-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]thiourea Openeye Name: 1-[2-(m-tolyl)ethyl]-3-[4-(3-nitrophenyl)thiazol-2-yl]thiourea CAS Name: 1-[2-(3-methylphenyl)ethyl]-3-[4-(3-nitrophenyl)-2-thiazolyl]thiourea IUPAC Name: 1-[2-(3-methylphenyl)ethyl]-3-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]thiourea Traditional Name: 1-[2-(m-tolyl)ethyl]-3-[4-(3-nitrophenyl)thiazol-2-yl]thiourea Formula: C19H18N4O2S2 MolecularWeight: 398.50182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCNC(=S)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CCNC(=S)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O2S2/c1-13-4-2-5-14(10-13)8-9-20-18(26)22-19-21-17(12-27-19)15-6-3-7-16(11-15)23(24)25/h2-7,10-12H,8-9H2,1H3,(H2,20,21,22,26)