N-cyclopropyl-2-(3-phenylprop-2-ynoylamino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide

Systemtic Name: N-cyclopropyl-2-(3-phenylprop-2-ynoylamino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide Openeye Name: N-cyclopropyl-2-(3-phenylprop-2-ynoylamino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide CAS Name: N-cyclopropyl-2-[(1-oxo-3-phenylprop-2-ynyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide IUPAC Name: N-cyclopropyl-2-(3-phenylprop-2-ynoylamino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide Traditional Name: N-cyclopropyl-2-[(3-phenylpropioloyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide Formula: C23H24N2O2S MolecularWeight: 392.51386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C(=C(S2)NC(=O)C#CC3=CC=CC=C3)C(=O)NC4CC4

Isomeric SMILES

C1CCCC2=C(CC1)C(=C(S2)NC(=O)C#CC3=CC=CC=C3)C(=O)NC4CC4

InChI

InChI=1S/C23H24N2O2S/c26-20(15-12-16-8-4-3-5-9-16)25-23-21(22(27)24-17-13-14-17)18-10-6-1-2-7-11-19(18)28-23/h3-5,8-9,17H,1-2,6-7,10-11,13-14H2,(H,24,27)(H,25,26)