1-[(E)-[7-isocyano-2-(3-methylimidazol-4-yl)quinolin-4-yl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[7-isocyano-2-(3-methylimidazol-4-yl)quinolin-4-yl]methylideneamino]thiourea Openeye Name: [(E)-[7-isocyano-2-(3-methylimidazol-4-yl)-4-quinolyl]methyleneamino]thiourea CAS Name: [(E)-[7-isocyano-2-(3-methyl-4-imidazolyl)-4-quinolinyl]methylideneamino]thiourea IUPAC Name: [(E)-[7-isocyano-2-(3-methylimidazol-4-yl)quinolin-4-yl]methylideneamino]thiourea Traditional Name: [(E)-[7-isocyano-2-(3-methylimidazol-4-yl)-4-quinolyl]methyleneamino]thiourea Formula: C16H13N7S MolecularWeight: 335.38632

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C2=NC3=C(C=CC(=C3)[N+]#[C-])C(=C2)C=NNC(=S)N

Isomeric SMILES

CN1C=NC=C1C2=NC3=C(C=CC(=C3)[N+]#[C-])C(=C2)/C=N/NC(=S)N

InChI

InChI=1S/C16H13N7S/c1-18-11-3-4-12-10(7-20-22-16(17)24)5-14(21-13(12)6-11)15-8-19-9-23(15)2/h3-9H,2H3,(H3,17,22,24)/b20-7+