1-butyl-3-[(Z)-[4-[2-cyanoethyl(methyl)amino]phenyl]methylideneamino]thiourea

Systemtic Name: 1-butyl-3-[(Z)-[4-[2-cyanoethyl(methyl)amino]phenyl]methylideneamino]thiourea Openeye Name: 1-butyl-3-[(Z)-[4-[2-cyanoethyl(methyl)amino]phenyl]methyleneamino]thiourea CAS Name: 1-butyl-3-[(Z)-[4-[2-cyanoethyl(methyl)amino]phenyl]methylideneamino]thiourea IUPAC Name: 1-butyl-3-[(Z)-[4-[2-cyanoethyl(methyl)amino]phenyl]methylideneamino]thiourea Traditional Name: 1-butyl-3-[(Z)-[4-[2-cyanoethyl(methyl)amino]benzylidene]amino]thiourea Formula: C16H23N5S MolecularWeight: 317.45232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=CC1=CC=C(C=C1)N(C)CCC#N

Isomeric SMILES

CCCCNC(=S)N/N=C\C1=CC=C(C=C1)N(C)CCC#N

InChI

InChI=1S/C16H23N5S/c1-3-4-11-18-16(22)20-19-13-14-6-8-15(9-7-14)21(2)12-5-10-17/h6-9,13H,3-5,11-12H2,1-2H3,(H2,18,20,22)/b19-13-