1,1-di(butan-2-yl)-3-(phenylmethyl)thiourea

Systemtic Name: 1,1-di(butan-2-yl)-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1,1-disec-butyl-thiourea CAS Name: 1,1-di(butan-2-yl)-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1,1-di(butan-2-yl)thiourea Traditional Name: 3-benzyl-1,1-disec-butyl-thiourea Formula: C16H26N2S MolecularWeight: 278.45604

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C(C)CC)C(=S)NCC1=CC=CC=C1

Isomeric SMILES

CCC(C)N(C(C)CC)C(=S)NCC1=CC=CC=C1

InChI

InChI=1S/C16H26N2S/c1-5-13(3)18(14(4)6-2)16(19)17-12-15-10-8-7-9-11-15/h7-11,13-14H,5-6,12H2,1-4H3,(H,17,19)