1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(Z)-1-(3-nitrophenyl)butylideneamino]thiourea CAS Name: 1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(Z)-1-(3-nitrophenyl)butylideneamino]thiourea Traditional Name: 1-benzyl-3-[(Z)-1-(3-nitrophenyl)butylideneamino]thiourea Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=S)NCC1=CC=CC=C1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC/C(=N/NC(=S)NCC1=CC=CC=C1)/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O2S/c1-2-7-17(15-10-6-11-16(12-15)22(23)24)20-21-18(25)19-13-14-8-4-3-5-9-14/h3-6,8-12H,2,7,13H2,1H3,(H2,19,21,25)/b20-17-