1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(Z)-1-(3-nitrophenyl)butylideneamino]thiourea CAS Name: 1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(Z)-1-(3-nitrophenyl)butylideneamino]thiourea Formula: C14H18N4O2S MolecularWeight: 306.38332

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=S)NCC=C)C1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C14H18N4O2S/c1-3-6-13(16-17-14(21)15-9-4-2)11-7-5-8-12(10-11)18(19)20/h4-5,7-8,10H,2-3,6,9H2,1H3,(H2,15,17,21)/b16-13-