6-methyl-4-oxidanylidene-N-[4-[(4-thiophen-2-ylcarbonyl-1,4-diazepan-1-yl)carbonyl]piperidin-4-yl]chromene-2-carboxamide

Systemtic Name: 6-methyl-4-oxidanylidene-N-[4-[(4-thiophen-2-ylcarbonyl-1,4-diazepan-1-yl)carbonyl]piperidin-4-yl]chromene-2-carboxamide Openeye Name: 6-methyl-4-oxo-N-[4-[4-(thiophene-2-carbonyl)-1,4-diazepane-1-carbonyl]-4-piperidyl]chromene-2-carboxamide CAS Name: 6-methyl-4-oxo-N-[4-[oxo-[4-[oxo(thiophen-2-yl)methyl]-1,4-diazepan-1-yl]methyl]-4-piperidinyl]-1-benzopyran-2-carboxamide IUPAC Name: 6-methyl-4-oxo-N-[4-[4-(thiophene-2-carbonyl)-1,4-diazepane-1-carbonyl]piperidin-4-yl]chromene-2-carboxamide Traditional Name: 4-keto-6-methyl-N-[4-[4-(2-thenoyl)-1,4-diazepane-1-carbonyl]-4-piperidyl]chromene-2-carboxamide Formula: C27H30N4O5S MolecularWeight: 522.6159

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)NC3(CCNCC3)C(=O)N4CCCN(CC4)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)NC3(CCNCC3)C(=O)N4CCCN(CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C27H30N4O5S/c1-18-5-6-21-19(16-18)20(32)17-22(36-21)24(33)29-27(7-9-28-10-8-27)26(35)31-12-3-11-30(13-14-31)25(34)23-4-2-15-37-23/h2,4-6,15-17,28H,3,7-14H2,1H3,(H,29,33)