1-(2-cyanoethyl)-3-(4-morpholin-4-ylsulfonylphenyl)-1-phenyl-thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(4-morpholin-4-ylsulfonylphenyl)-1-phenyl-thiourea Openeye Name: 1-(2-cyanoethyl)-3-(4-morpholinosulfonylphenyl)-1-phenyl-thiourea CAS Name: 1-(2-cyanoethyl)-3-[4-(4-morpholinylsulfonyl)phenyl]-1-phenylthiourea IUPAC Name: 1-(2-cyanoethyl)-3-(4-morpholin-4-ylsulfonylphenyl)-1-phenylthiourea Traditional Name: 1-(2-cyanoethyl)-3-(4-morpholinosulfonylphenyl)-1-phenyl-thiourea Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)N(CCC#N)C3=CC=CC=C3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)N(CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3S2/c21-11-4-12-24(18-5-2-1-3-6-18)20(28)22-17-7-9-19(10-8-17)29(25,26)23-13-15-27-16-14-23/h1-3,5-10H,4,12-16H2,(H,22,28)