N-[1-(4-methylphenyl)carbonyl-5-piperazin-1-ylcarbonyl-pyrrolidin-3-yl]-N-phenethyl-thiophene-2-carboxamide

Systemtic Name: N-[1-(4-methylphenyl)carbonyl-5-piperazin-1-ylcarbonyl-pyrrolidin-3-yl]-N-phenethyl-thiophene-2-carboxamide Openeye Name: N-[1-(4-methylbenzoyl)-5-(piperazine-1-carbonyl)pyrrolidin-3-yl]-N-phenethyl-thiophene-2-carboxamide CAS Name: N-[1-[(4-methylphenyl)-oxomethyl]-5-[oxo(1-piperazinyl)methyl]-3-pyrrolidinyl]-N-phenethyl-2-thiophenecarboxamide IUPAC Name: N-[1-(4-methylbenzoyl)-5-(piperazine-1-carbonyl)pyrrolidin-3-yl]-N-phenethylthiophene-2-carboxamide Traditional Name: N-phenethyl-N-[5-(piperazine-1-carbonyl)-1-p-toluoyl-pyrrolidin-3-yl]thiophene-2-carboxamide Formula: C30H34N4O3S MolecularWeight: 530.68096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)N3CCNCC3)N(CCC4=CC=CC=C4)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)N3CCNCC3)N(CCC4=CC=CC=C4)C(=O)C5=CC=CS5

InChI

InChI=1S/C30H34N4O3S/c1-22-9-11-24(12-10-22)28(35)34-21-25(20-26(34)29(36)32-17-14-31-15-18-32)33(30(37)27-8-5-19-38-27)16-13-23-6-3-2-4-7-23/h2-12,19,25-26,31H,13-18,20-21H2,1H3