N-[2-[1-[(4-bromophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanyl-1,3-benzothiazol-6-yl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[2-[1-[(4-bromophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanyl-1,3-benzothiazol-6-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[2-[1-[(4-bromophenyl)carbamoyl]propylsulfanyl]-1,3-benzothiazol-6-yl]-3,4-dimethoxy-benzamide CAS Name: N-[2-[[1-(4-bromoanilino)-1-oxobutan-2-yl]thio]-1,3-benzothiazol-6-yl]-3,4-dimethoxybenzamide IUPAC Name: N-[2-[1-(4-bromoanilino)-1-oxobutan-2-yl]sulfanyl-1,3-benzothiazol-6-yl]-3,4-dimethoxybenzamide Traditional Name: N-[2-[1-[(4-bromophenyl)carbamoyl]propylthio]-1,3-benzothiazol-6-yl]-3,4-dimethoxy-benzamide Formula: C26H24BrN3O4S2 MolecularWeight: 586.52046

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)Br)SC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)Br)SC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H24BrN3O4S2/c1-4-22(25(32)28-17-8-6-16(27)7-9-17)35-26-30-19-11-10-18(14-23(19)36-26)29-24(31)15-5-12-20(33-2)21(13-15)34-3/h5-14,22H,4H2,1-3H3,(H,28,32)(H,29,31)