N-[(3aR,6aS)-3-cyano-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[(3aR,6aS)-3-cyano-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[(3aR,6aS)-3-cyano-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[(3aR,6aS)-3-cyano-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[(3aR,6aS)-3-cyano-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[(3aR,6aS)-3-cyano-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl]-3-nitro-4-pyrrolidino-benzamide Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C4CCCC4S3)C#N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C([C@H]4CCC[C@@H]4S3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O3S/c20-11-14-13-4-3-5-17(13)27-19(14)21-18(24)12-6-7-15(16(10-12)23(25)26)22-8-1-2-9-22/h6-7,10,13,17H,1-5,8-9H2,(H,21,24)/t13-,17+/m1/s1