N-[2-[2-(3-phenylpropyl)-1,5-dihydro-2,4-benzodiazepin-5-yl]phenyl]propanamide

Systemtic Name: N-[2-[2-(3-phenylpropyl)-1,5-dihydro-2,4-benzodiazepin-5-yl]phenyl]propanamide Openeye Name: N-[2-[2-(3-phenylpropyl)-1,5-dihydro-2,4-benzodiazepin-5-yl]phenyl]propanamide CAS Name: N-[2-[2-(3-phenylpropyl)-1,5-dihydro-2,4-benzodiazepin-5-yl]phenyl]propanamide IUPAC Name: N-[2-[2-(3-phenylpropyl)-1,5-dihydro-2,4-benzodiazepin-5-yl]phenyl]propanamide Traditional Name: N-[2-[2-(3-phenylpropyl)-1,5-dihydro-2,4-benzodiazepin-5-yl]phenyl]propionamide Formula: C27H29N3O MolecularWeight: 411.53866

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC=C1C2C3=CC=CC=C3CN(C=N2)CCCC4=CC=CC=C4

Isomeric SMILES

CCC(=O)NC1=CC=CC=C1C2C3=CC=CC=C3CN(C=N2)CCCC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O/c1-2-26(31)29-25-17-9-8-16-24(25)27-23-15-7-6-14-22(23)19-30(20-28-27)18-10-13-21-11-4-3-5-12-21/h3-9,11-12,14-17,20,27H,2,10,13,18-19H2,1H3,(H,29,31)