4-(4-methoxyphenyl)sulfonyl-N-(phenylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-(4-methoxyphenyl)sulfonyl-N-(phenylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)butanamide Openeye Name: N-benzyl-N-(4-isopropyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)sulfonyl-butanamide CAS Name: 4-(4-methoxyphenyl)sulfonyl-N-(phenylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: N-benzyl-4-(4-methoxyphenyl)sulfonyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)butanamide Traditional Name: N-benzyl-N-(4-isopropyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)sulfonyl-butyramide Formula: C28H30N2O4S2 MolecularWeight: 522.6788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CCCS(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CCCS(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C28H30N2O4S2/c1-20(2)24-11-7-12-25-27(24)29-28(35-25)30(19-21-9-5-4-6-10-21)26(31)13-8-18-36(32,33)23-16-14-22(34-3)15-17-23/h4-7,9-12,14-17,20H,8,13,18-19H2,1-3H3