3,3-diphenyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3,3-diphenyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3,3-diphenyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3,3-diphenyl-N-[6-(1-pyrrolidinylsulfonyl)-1,3-benzothiazol-2-yl]propanamide IUPAC Name: 3,3-diphenyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3,3-diphenyl-N-(6-pyrrolidinosulfonyl-1,3-benzothiazol-2-yl)propionamide Formula: C26H25N3O3S2 MolecularWeight: 491.625

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H25N3O3S2/c30-25(18-22(19-9-3-1-4-10-19)20-11-5-2-6-12-20)28-26-27-23-14-13-21(17-24(23)33-26)34(31,32)29-15-7-8-16-29/h1-6,9-14,17,22H,7-8,15-16,18H2,(H,27,28,30)