azepan-1-yl-[5-(2,3-dihydro-1H-inden-2-ylamino)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name: azepan-1-yl-[5-(2,3-dihydro-1H-inden-2-ylamino)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-3-yl]methanone Openeye Name: [1-allyl-5-(indan-2-ylamino)-4,5,6,7-tetrahydroindazol-3-yl]-(azepan-1-yl)methanone CAS Name: 1-azepanyl-[5-(2,3-dihydro-1H-inden-2-ylamino)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-3-yl]methanone IUPAC Name: azepan-1-yl-[5-(2,3-dihydro-1H-inden-2-ylamino)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-3-yl]methanone Traditional Name: [1-allyl-5-(indan-2-ylamino)-4,5,6,7-tetrahydroindazol-3-yl]-(azepan-1-yl)methanone Formula: C26H34N4O MolecularWeight: 418.57436

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(CC(CC2)NC3CC4=CC=CC=C4C3)C(=N1)C(=O)N5CCCCCC5

Isomeric SMILES

C=CCN1C2=C(CC(CC2)NC3CC4=CC=CC=C4C3)C(=N1)C(=O)N5CCCCCC5

InChI

InChI=1S/C26H34N4O/c1-2-13-30-24-12-11-21(27-22-16-19-9-5-6-10-20(19)17-22)18-23(24)25(28-30)26(31)29-14-7-3-4-8-15-29/h2,5-6,9-10,21-22,27H,1,3-4,7-8,11-18H2