1-[[4-(methylamino)-3-nitro-phenyl]carbonylamino]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[[4-(methylamino)-3-nitro-phenyl]carbonylamino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-[[4-(methylamino)-3-nitro-benzoyl]amino]thiourea CAS Name: 1-[[[4-(methylamino)-3-nitrophenyl]-oxomethyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[[4-(methylamino)-3-nitrobenzoyl]amino]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[[4-(methylamino)-3-nitro-benzoyl]amino]-3-p-cumenyl-thiourea Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N5O3S/c1-11(2)12-4-7-14(8-5-12)20-18(27)22-21-17(24)13-6-9-15(19-3)16(10-13)23(25)26/h4-11,19H,1-3H3,(H,21,24)(H2,20,22,27)