1,1-bis(2-cyanoethyl)-3-(2-methoxy-5-phenyl-phenyl)thiourea

Systemtic Name: 1,1-bis(2-cyanoethyl)-3-(2-methoxy-5-phenyl-phenyl)thiourea Openeye Name: 1,1-bis(2-cyanoethyl)-3-(2-methoxy-5-phenyl-phenyl)thiourea CAS Name: 1,1-bis(2-cyanoethyl)-3-(2-methoxy-5-phenylphenyl)thiourea IUPAC Name: 1,1-bis(2-cyanoethyl)-3-(2-methoxy-5-phenylphenyl)thiourea Traditional Name: 1,1-bis(2-cyanoethyl)-3-(2-methoxy-5-phenyl-phenyl)thiourea Formula: C20H20N4OS MolecularWeight: 364.464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC=CC=C2)NC(=S)N(CCC#N)CCC#N

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC=CC=C2)NC(=S)N(CCC#N)CCC#N

InChI

InChI=1S/C20H20N4OS/c1-25-19-10-9-17(16-7-3-2-4-8-16)15-18(19)23-20(26)24(13-5-11-21)14-6-12-22/h2-4,7-10,15H,5-6,13-14H2,1H3,(H,23,26)