N-(4-phenylazanylphenyl)-N-propan-2-yl-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-phenylazanylphenyl)-N-propan-2-yl-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-anilinophenyl)-N-isopropyl-acetamide CAS Name: N-(4-anilinophenyl)-N-propan-2-yl-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: N-(4-anilinophenyl)-N-propan-2-yl-2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(4-anilinophenyl)-N-isopropyl-acetamide Formula: C22H25N5OS2 MolecularWeight: 439.5968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=C(C=C1)NC2=CC=CC=C2)C(=O)CSC3=NN=C(S3)NCC=C

Isomeric SMILES

CC(C)N(C1=CC=C(C=C1)NC2=CC=CC=C2)C(=O)CSC3=NN=C(S3)NCC=C

InChI

InChI=1S/C22H25N5OS2/c1-4-14-23-21-25-26-22(30-21)29-15-20(28)27(16(2)3)19-12-10-18(11-13-19)24-17-8-6-5-7-9-17/h4-13,16,24H,1,14-15H2,2-3H3,(H,23,25)