N-cyclopropyl-N-[5-(1,4-diazepan-1-ylcarbonyl)-1-(4-methylphenyl)carbonyl-pyrrolidin-3-yl]thiophene-2-carboxamide

Systemtic Name: N-cyclopropyl-N-[5-(1,4-diazepan-1-ylcarbonyl)-1-(4-methylphenyl)carbonyl-pyrrolidin-3-yl]thiophene-2-carboxamide Openeye Name: N-cyclopropyl-N-[5-(1,4-diazepane-1-carbonyl)-1-(4-methylbenzoyl)pyrrolidin-3-yl]thiophene-2-carboxamide CAS Name: N-cyclopropyl-N-[5-[1,4-diazepan-1-yl(oxo)methyl]-1-[(4-methylphenyl)-oxomethyl]-3-pyrrolidinyl]-2-thiophenecarboxamide IUPAC Name: N-cyclopropyl-N-[5-(1,4-diazepane-1-carbonyl)-1-(4-methylbenzoyl)pyrrolidin-3-yl]thiophene-2-carboxamide Traditional Name: N-cyclopropyl-N-[5-(1,4-diazepane-1-carbonyl)-1-p-toluoyl-pyrrolidin-3-yl]thiophene-2-carboxamide Formula: C26H32N4O3S MolecularWeight: 480.62228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)N3CCCNCC3)N(C4CC4)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)N3CCCNCC3)N(C4CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C26H32N4O3S/c1-18-5-7-19(8-6-18)24(31)29-17-21(16-22(29)25(32)28-13-3-11-27-12-14-28)30(20-9-10-20)26(33)23-4-2-15-34-23/h2,4-8,15,20-22,27H,3,9-14,16-17H2,1H3