N-[1-cyclopropylcarbonyl-5-(1,4-diazepan-1-ylcarbonyl)pyrrolidin-3-yl]-N-[(3-methoxyphenyl)methyl]thiophene-2-carboxamide

Systemtic Name: N-[1-cyclopropylcarbonyl-5-(1,4-diazepan-1-ylcarbonyl)pyrrolidin-3-yl]-N-[(3-methoxyphenyl)methyl]thiophene-2-carboxamide Openeye Name: N-[1-(cyclopropanecarbonyl)-5-(1,4-diazepane-1-carbonyl)pyrrolidin-3-yl]-N-[(3-methoxyphenyl)methyl]thiophene-2-carboxamide CAS Name: N-[1-[cyclopropyl(oxo)methyl]-5-[1,4-diazepan-1-yl(oxo)methyl]-3-pyrrolidinyl]-N-[(3-methoxyphenyl)methyl]-2-thiophenecarboxamide IUPAC Name: N-[1-(cyclopropanecarbonyl)-5-(1,4-diazepane-1-carbonyl)pyrrolidin-3-yl]-N-[(3-methoxyphenyl)methyl]thiophene-2-carboxamide Traditional Name: N-[1-(cyclopropanecarbonyl)-5-(1,4-diazepane-1-carbonyl)pyrrolidin-3-yl]-N-m-anisyl-thiophene-2-carboxamide Formula: C27H34N4O4S MolecularWeight: 510.64826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(C2CC(N(C2)C(=O)C3CC3)C(=O)N4CCCNCC4)C(=O)C5=CC=CS5

Isomeric SMILES

COC1=CC=CC(=C1)CN(C2CC(N(C2)C(=O)C3CC3)C(=O)N4CCCNCC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C27H34N4O4S/c1-35-22-6-2-5-19(15-22)17-30(27(34)24-7-3-14-36-24)21-16-23(31(18-21)25(32)20-8-9-20)26(33)29-12-4-10-28-11-13-29/h2-3,5-7,14-15,20-21,23,28H,4,8-13,16-18H2,1H3