3-(4-tert-butylphenyl)-1-(2-cyanoethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(4-tert-butylphenyl)-1-(2-cyanoethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(4-tert-butylphenyl)-1-(2-cyanoethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-(4-tert-butylphenyl)-1-(2-cyanoethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(4-tert-butylphenyl)-1-(2-cyanoethyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(4-tert-butylphenyl)-1-(2-cyanoethyl)-1-(3-pyridylmethyl)thiourea Formula: C20H24N4S MolecularWeight: 352.49636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4S/c1-20(2,3)17-7-9-18(10-8-17)23-19(25)24(13-5-11-21)15-16-6-4-12-22-14-16/h4,6-10,12,14H,5,13,15H2,1-3H3,(H,23,25)