1-(2,3-dimethylphenyl)-3-[(Z)-(4-piperidin-1-ylphenyl)methylideneamino]thiourea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[(Z)-(4-piperidin-1-ylphenyl)methylideneamino]thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-[(Z)-[4-(1-piperidyl)phenyl]methyleneamino]thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[(Z)-[4-(1-piperidinyl)phenyl]methylideneamino]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[(Z)-(4-piperidin-1-ylphenyl)methylideneamino]thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-[(Z)-(4-piperidinobenzylidene)amino]thiourea Formula: C21H26N4S MolecularWeight: 366.52294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NN=CC2=CC=C(C=C2)N3CCCCC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)N/N=C\C2=CC=C(C=C2)N3CCCCC3)C

InChI

InChI=1S/C21H26N4S/c1-16-7-6-8-20(17(16)2)23-21(26)24-22-15-18-9-11-19(12-10-18)25-13-4-3-5-14-25/h6-12,15H,3-5,13-14H2,1-2H3,(H2,23,24,26)/b22-15-