N-[2-methyl-5-(1,2,3,4-tetrazol-1-yl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[2-methyl-5-(1,2,3,4-tetrazol-1-yl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[2-methyl-5-(tetrazol-1-yl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[2-methyl-5-(1-tetrazolyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[2-methyl-5-(tetrazol-1-yl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[2-methyl-5-(tetrazol-1-yl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C18H18N6O MolecularWeight: 334.37512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=NN=N2)NC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=NN=N2)NC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C18H18N6O/c1-13-6-7-16(24-12-19-21-22-24)10-17(13)20-18(25)23-9-8-14-4-2-3-5-15(14)11-23/h2-7,10,12H,8-9,11H2,1H3,(H,20,25)