1-[2-(1,4-diazepan-1-ylmethyl)prop-2-enyl]-1-(3,3-diphenylpropyl)-3-phenethyl-urea

Systemtic Name: 1-[2-(1,4-diazepan-1-ylmethyl)prop-2-enyl]-1-(3,3-diphenylpropyl)-3-phenethyl-urea Openeye Name: 1-[2-(1,4-diazepan-1-ylmethyl)allyl]-1-(3,3-diphenylpropyl)-3-phenethyl-urea CAS Name: 1-[2-(1,4-diazepan-1-ylmethyl)prop-2-enyl]-1-(3,3-diphenylpropyl)-3-phenethylurea IUPAC Name: 1-[2-(1,4-diazepan-1-ylmethyl)prop-2-enyl]-1-(3,3-diphenylpropyl)-3-phenethylurea Traditional Name: 1-[2-(1,4-diazepan-1-ylmethyl)allyl]-1-(3,3-diphenylpropyl)-3-phenethyl-urea Formula: C33H42N4O MolecularWeight: 510.71278

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CN1CCCNCC1)CN(CCC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C=C(CN1CCCNCC1)CN(CCC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C33H42N4O/c1-28(26-36-23-11-20-34-22-25-36)27-37(33(38)35-21-18-29-12-5-2-6-13-29)24-19-32(30-14-7-3-8-15-30)31-16-9-4-10-17-31/h2-10,12-17,32,34H,1,11,18-27H2,(H,35,38)