N-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide

Systemtic Name: N-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: N-[[4-(3-bromophenyl)thiazol-2-yl]carbamothioyl]-3-(4-morpholinosulfonylphenyl)propanamide CAS Name: N-[[[4-(3-bromophenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-3-[4-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: N-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: N-[[4-(3-bromophenyl)thiazol-2-yl]thiocarbamoyl]-3-(4-morpholinosulfonylphenyl)propionamide Formula: C23H23BrN4O4S3 MolecularWeight: 595.55212

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC(=S)NC3=NC(=CS3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC(=S)NC3=NC(=CS3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C23H23BrN4O4S3/c24-18-3-1-2-17(14-18)20-15-34-23(25-20)27-22(33)26-21(29)9-6-16-4-7-19(8-5-16)35(30,31)28-10-12-32-13-11-28/h1-5,7-8,14-15H,6,9-13H2,(H2,25,26,27,29,33)