1-[(3-methyl-4-nitro-phenyl)carbonylamino]-3-phenethyl-thiourea

Systemtic Name: 1-[(3-methyl-4-nitro-phenyl)carbonylamino]-3-phenethyl-thiourea Openeye Name: 1-[(3-methyl-4-nitro-benzoyl)amino]-3-phenethyl-thiourea CAS Name: 1-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]-3-phenethylthiourea IUPAC Name: 1-[(3-methyl-4-nitrobenzoyl)amino]-3-phenethylthiourea Traditional Name: 1-[(3-methyl-4-nitro-benzoyl)amino]-3-phenethyl-thiourea Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NNC(=S)NCCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NNC(=S)NCCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O3S/c1-12-11-14(7-8-15(12)21(23)24)16(22)19-20-17(25)18-10-9-13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H,19,22)(H2,18,20,25)