3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide hydrochloride

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide hydrochloride Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(4-phenylthiazol-2-yl)benzamide hydrochloride CAS Name: 3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-N-(4-phenyl-2-thiazolyl)benzamide hydrochloride IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide hydrochloride Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-(4-phenylthiazol-2-yl)benzamide hydrochloride Formula: C27H27ClN4O3S2 MolecularWeight: 555.11128

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=NC(=CS4)C5=CC=CC=C5.Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=NC(=CS4)C5=CC=CC=C5.Cl

InChI

InChI=1S/C27H26N4O3S2.ClH/c32-26(29-27-28-25(20-35-27)22-10-5-2-6-11-22)23-12-7-13-24(18-23)36(33,34)31-16-14-30(15-17-31)19-21-8-3-1-4-9-21;/h1-13,18,20H,14-17,19H2,(H,28,29,32);1H