3-butyl-1-[(E)-[4-(cyanomethoxy)-3-methoxy-phenyl]methylideneamino]-1-methyl-thiourea

Systemtic Name: 3-butyl-1-[(E)-[4-(cyanomethoxy)-3-methoxy-phenyl]methylideneamino]-1-methyl-thiourea Openeye Name: 3-butyl-1-[(E)-[4-(cyanomethoxy)-3-methoxy-phenyl]methyleneamino]-1-methyl-thiourea CAS Name: 3-butyl-1-[(E)-[4-(cyanomethoxy)-3-methoxyphenyl]methylideneamino]-1-methylthiourea IUPAC Name: 3-butyl-1-[(E)-[4-(cyanomethoxy)-3-methoxyphenyl]methylideneamino]-1-methylthiourea Traditional Name: 3-butyl-1-[(E)-[4-(cyanomethoxy)-3-methoxy-benzylidene]amino]-1-methyl-thiourea Formula: C16H22N4O2S MolecularWeight: 334.43648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(C)N=CC1=CC(=C(C=C1)OCC#N)OC

Isomeric SMILES

CCCCNC(=S)N(C)/N=C/C1=CC(=C(C=C1)OCC#N)OC

InChI

InChI=1S/C16H22N4O2S/c1-4-5-9-18-16(23)20(2)19-12-13-6-7-14(22-10-8-17)15(11-13)21-3/h6-7,11-12H,4-5,9-10H2,1-3H3,(H,18,23)/b19-12+