3-[(2S)-butan-2-yl]-1-(phenylmethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-[(2S)-butan-2-yl]-1-(phenylmethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-benzyl-3-[(1S)-1-methylpropyl]-1-(3-pyridylmethyl)thiourea CAS Name: 3-[(2S)-butan-2-yl]-1-(phenylmethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(2S)-butan-2-yl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-benzyl-3-[(1S)-1-methylpropyl]-1-(3-pyridylmethyl)thiourea Formula: C18H23N3S MolecularWeight: 313.46032

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=S)N(CC1=CC=CC=C1)CC2=CN=CC=C2

Isomeric SMILES

CC[C@H](C)NC(=S)N(CC1=CC=CC=C1)CC2=CN=CC=C2

InChI

InChI=1S/C18H23N3S/c1-3-15(2)20-18(22)21(13-16-8-5-4-6-9-16)14-17-10-7-11-19-12-17/h4-12,15H,3,13-14H2,1-2H3,(H,20,22)/t15-/m0/s1