1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(4-bromophenyl)propyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(4-bromophenyl)propyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(4-bromophenyl)propyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(4-bromophenyl)propyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(4-bromophenyl)propyl]thiourea Traditional Name: 1-[(1R)-1-(4-bromophenyl)propyl]-3-piperonyl-thiourea Formula: C18H19BrN2O2S MolecularWeight: 407.32466

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)NC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC[C@H](C1=CC=C(C=C1)Br)NC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H19BrN2O2S/c1-2-15(13-4-6-14(19)7-5-13)21-18(24)20-10-12-3-8-16-17(9-12)23-11-22-16/h3-9,15H,2,10-11H2,1H3,(H2,20,21,24)/t15-/m1/s1