1-(2-cyanoethyl)-3-(2,6-diethylphenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(2,6-diethylphenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-(2-cyanoethyl)-3-(2,6-diethylphenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-(2-cyanoethyl)-3-(2,6-diethylphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(2,6-diethylphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(2-cyanoethyl)-3-(2,6-diethylphenyl)-1-(3-pyridylmethyl)thiourea Formula: C20H24N4S MolecularWeight: 352.49636

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N(CCC#N)CC2=CN=CC=C2

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N(CCC#N)CC2=CN=CC=C2

InChI

InChI=1S/C20H24N4S/c1-3-17-9-5-10-18(4-2)19(17)23-20(25)24(13-7-11-21)15-16-8-6-12-22-14-16/h5-6,8-10,12,14H,3-4,7,13,15H2,1-2H3,(H,23,25)