N-(phenylmethyl)-3-(phenylsulfonyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: N-(phenylmethyl)-3-(phenylsulfonyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-benzyl-N-(4-isopropyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(benzenesulfonyl)-N-(phenylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(benzenesulfonyl)-N-benzyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)propanamide Traditional Name: N-benzyl-3-besyl-N-(4-isopropyl-1,3-benzothiazol-2-yl)propionamide Formula: C26H26N2O3S2 MolecularWeight: 478.62624

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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)CCS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C26H26N2O3S2/c1-19(2)22-14-9-15-23-25(22)27-26(32-23)28(18-20-10-5-3-6-11-20)24(29)16-17-33(30,31)21-12-7-4-8-13-21/h3-15,19H,16-18H2,1-2H3