N-(2-acetamidoethyl)-4-[[3-[(4-phenylphenyl)methyl]imidazol-4-yl]methylamino]-3,4-dihydro-2H-chromene-8-carboxamide

Systemtic Name: N-(2-acetamidoethyl)-4-[[3-[(4-phenylphenyl)methyl]imidazol-4-yl]methylamino]-3,4-dihydro-2H-chromene-8-carboxamide Openeye Name: N-(2-acetamidoethyl)-4-[[3-[(4-phenylphenyl)methyl]imidazol-4-yl]methylamino]chromane-8-carboxamide CAS Name: N-(2-acetamidoethyl)-4-[[3-[(4-phenylphenyl)methyl]-4-imidazolyl]methylamino]-3,4-dihydro-2H-1-benzopyran-8-carboxamide IUPAC Name: N-(2-acetamidoethyl)-4-[[3-[(4-phenylphenyl)methyl]imidazol-4-yl]methylamino]-3,4-dihydro-2H-chromene-8-carboxamide Traditional Name: N-(2-acetamidoethyl)-4-[[3-(4-phenylbenzyl)imidazol-4-yl]methylamino]chroman-8-carboxamide Formula: C31H33N5O3 MolecularWeight: 523.62542

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1=C2C(=CC=C1)C(CCO2)NCC3=CN=CN3CC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)NCCNC(=O)C1=C2C(=CC=C1)C(CCO2)NCC3=CN=CN3CC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H33N5O3/c1-22(37)33-15-16-34-31(38)28-9-5-8-27-29(14-17-39-30(27)28)35-19-26-18-32-21-36(26)20-23-10-12-25(13-11-23)24-6-3-2-4-7-24/h2-13,18,21,29,35H,14-17,19-20H2,1H3,(H,33,37)(H,34,38)