1-[2-[2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-1-yl]ethanoylamino]-3-tert-butyl-thiourea

Systemtic Name: 1-[2-[2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-1-yl]ethanoylamino]-3-tert-butyl-thiourea Openeye Name: 1-[[2-(3-benzyl-2,6-dioxo-pyrimidin-1-yl)acetyl]amino]-3-tert-butyl-thiourea CAS Name: 1-tert-butyl-3-[[2-[2,6-dioxo-3-(phenylmethyl)-1-pyrimidinyl]-1-oxoethyl]amino]thiourea IUPAC Name: 1-[[2-(3-benzyl-2,6-dioxopyrimidin-1-yl)acetyl]amino]-3-tert-butylthiourea Traditional Name: 1-[[2-(3-benzyl-2,6-diketo-pyrimidin-1-yl)acetyl]amino]-3-tert-butyl-thiourea Formula: C18H23N5O3S MolecularWeight: 389.47192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)CN1C(=O)C=CN(C1=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)CN1C(=O)C=CN(C1=O)CC2=CC=CC=C2

InChI

InChI=1S/C18H23N5O3S/c1-18(2,3)19-16(27)21-20-14(24)12-23-15(25)9-10-22(17(23)26)11-13-7-5-4-6-8-13/h4-10H,11-12H2,1-3H3,(H,20,24)(H2,19,21,27)