N-cyclopropyl-N-[[2-(4-ethanoylpiperazin-1-yl)-7-methyl-quinolin-3-yl]methyl]-3-methyl-thiophene-2-carboxamide

Systemtic Name: N-cyclopropyl-N-[[2-(4-ethanoylpiperazin-1-yl)-7-methyl-quinolin-3-yl]methyl]-3-methyl-thiophene-2-carboxamide Openeye Name: N-[[2-(4-acetylpiperazin-1-yl)-7-methyl-3-quinolyl]methyl]-N-cyclopropyl-3-methyl-thiophene-2-carboxamide CAS Name: N-[[2-(4-acetyl-1-piperazinyl)-7-methyl-3-quinolinyl]methyl]-N-cyclopropyl-3-methyl-2-thiophenecarboxamide IUPAC Name: N-[[2-(4-acetylpiperazin-1-yl)-7-methylquinolin-3-yl]methyl]-N-cyclopropyl-3-methylthiophene-2-carboxamide Traditional Name: N-[[2-(4-acetylpiperazino)-7-methyl-3-quinolyl]methyl]-N-cyclopropyl-3-methyl-thiophene-2-carboxamide Formula: C26H30N4O2S MolecularWeight: 462.607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)CN(C3CC3)C(=O)C4=C(C=CS4)C)N5CCN(CC5)C(=O)C

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)CN(C3CC3)C(=O)C4=C(C=CS4)C)N5CCN(CC5)C(=O)C

InChI

InChI=1S/C26H30N4O2S/c1-17-4-5-20-15-21(16-30(22-6-7-22)26(32)24-18(2)8-13-33-24)25(27-23(20)14-17)29-11-9-28(10-12-29)19(3)31/h4-5,8,13-15,22H,6-7,9-12,16H2,1-3H3