N-[3-(1,3-dithian-2-yl)phenyl]-4-pyrrol-1-yl-benzamide

Systemtic Name: N-[3-(1,3-dithian-2-yl)phenyl]-4-pyrrol-1-yl-benzamide Openeye Name: N-[3-(1,3-dithian-2-yl)phenyl]-4-pyrrol-1-yl-benzamide CAS Name: N-[3-(1,3-dithian-2-yl)phenyl]-4-(1-pyrrolyl)benzamide IUPAC Name: N-[3-(1,3-dithian-2-yl)phenyl]-4-pyrrol-1-ylbenzamide Traditional Name: N-[3-(1,3-dithian-2-yl)phenyl]-4-pyrrol-1-yl-benzamide Formula: C21H20N2OS2 MolecularWeight: 380.5263

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C21H20N2OS2/c24-20(16-7-9-19(10-8-16)23-11-1-2-12-23)22-18-6-3-5-17(15-18)21-25-13-4-14-26-21/h1-3,5-12,15,21H,4,13-14H2,(H,22,24)