1,3-bis[(3-bromophenyl)-piperidin-1-yl-methyl]thiourea

Systemtic Name: 1,3-bis[(3-bromophenyl)-piperidin-1-yl-methyl]thiourea Openeye Name: 1,3-bis[(3-bromophenyl)-(1-piperidyl)methyl]thiourea CAS Name: 1,3-bis[(3-bromophenyl)-(1-piperidinyl)methyl]thiourea IUPAC Name: 1,3-bis[(3-bromophenyl)-piperidin-1-ylmethyl]thiourea Traditional Name: 1,3-bis[(3-bromophenyl)-piperidino-methyl]thiourea Formula: C25H32Br2N4S MolecularWeight: 580.42138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(C2=CC(=CC=C2)Br)NC(=S)NC(C3=CC(=CC=C3)Br)N4CCCCC4

Isomeric SMILES

C1CCN(CC1)C(C2=CC(=CC=C2)Br)NC(=S)NC(C3=CC(=CC=C3)Br)N4CCCCC4

InChI

InChI=1S/C25H32Br2N4S/c26-21-11-7-9-19(17-21)23(30-13-3-1-4-14-30)28-25(32)29-24(31-15-5-2-6-16-31)20-10-8-12-22(27)18-20/h7-12,17-18,23-24H,1-6,13-16H2,(H2,28,29,32)