3-(cyclohexylmethyl)-2-[(E)-2-phenylethenyl]-N-propan-2-yl-4H-quinazoline-7-carboxamide

Systemtic Name: 3-(cyclohexylmethyl)-2-[(E)-2-phenylethenyl]-N-propan-2-yl-4H-quinazoline-7-carboxamide Openeye Name: 3-(cyclohexylmethyl)-N-isopropyl-2-[(E)-styryl]-4H-quinazoline-7-carboxamide CAS Name: 3-(cyclohexylmethyl)-2-[(E)-2-phenylethenyl]-N-propan-2-yl-4H-quinazoline-7-carboxamide IUPAC Name: 3-(cyclohexylmethyl)-2-[(E)-2-phenylethenyl]-N-propan-2-yl-4H-quinazoline-7-carboxamide Traditional Name: 3-(cyclohexylmethyl)-N-isopropyl-2-[(E)-styryl]-4H-quinazoline-7-carboxamide Formula: C27H33N3O MolecularWeight: 415.57042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC2=C(CN(C(=N2)C=CC3=CC=CC=C3)CC4CCCCC4)C=C1

Isomeric SMILES

CC(C)NC(=O)C1=CC2=C(CN(C(=N2)/C=C/C3=CC=CC=C3)CC4CCCCC4)C=C1

InChI

InChI=1S/C27H33N3O/c1-20(2)28-27(31)23-14-15-24-19-30(18-22-11-7-4-8-12-22)26(29-25(24)17-23)16-13-21-9-5-3-6-10-21/h3,5-6,9-10,13-17,20,22H,4,7-8,11-12,18-19H2,1-2H3,(H,28,31)/b16-13+