1-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methylideneamino]-3-(3-methoxyphenyl)thiourea

Systemtic Name: 1-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methylideneamino]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methyleneamino]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[(Z)-[1-(2-cyanoethyl)-3-indolyl]methylideneamino]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methylideneamino]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methyleneamino]-3-(3-methoxyphenyl)thiourea Formula: C20H19N5OS MolecularWeight: 377.46276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NN=CC2=CN(C3=CC=CC=C32)CCC#N

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N/N=C\C2=CN(C3=CC=CC=C32)CCC#N

InChI

InChI=1S/C20H19N5OS/c1-26-17-7-4-6-16(12-17)23-20(27)24-22-13-15-14-25(11-5-10-21)19-9-3-2-8-18(15)19/h2-4,6-9,12-14H,5,11H2,1H3,(H2,23,24,27)/b22-13-