1-methyl-1-[(Z)-[5-(3-nitrophenyl)furan-2-yl]methylideneamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-methyl-1-[(Z)-[5-(3-nitrophenyl)furan-2-yl]methylideneamino]-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-methyl-1-[(Z)-[5-(3-nitrophenyl)-2-furyl]methyleneamino]thiourea CAS Name: 1-methyl-1-[(Z)-[5-(3-nitrophenyl)-2-furanyl]methylideneamino]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-methyl-1-[(Z)-[5-(3-nitrophenyl)furan-2-yl]methylideneamino]thiourea Traditional Name: 3-benzyl-1-methyl-1-[(Z)-[5-(3-nitrophenyl)-2-furyl]methyleneamino]thiourea Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCC1=CC=CC=C1)N=CC2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C(=S)NCC1=CC=CC=C1)/N=C\C2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O3S/c1-23(20(28)21-13-15-6-3-2-4-7-15)22-14-18-10-11-19(27-18)16-8-5-9-17(12-16)24(25)26/h2-12,14H,13H2,1H3,(H,21,28)/b22-14-