1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-cyclopropyl-1-(3-methylbutyl)thiourea

Systemtic Name: 1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-cyclopropyl-1-(3-methylbutyl)thiourea Openeye Name: 1-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-3-cyclopropyl-1-isopentyl-thiourea CAS Name: 1-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-3-cyclopropyl-1-(3-methylbutyl)thiourea IUPAC Name: 1-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-3-cyclopropyl-1-(3-methylbutyl)thiourea Traditional Name: 1-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-3-cyclopropyl-1-isoamyl-thiourea Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=S)NC3CC3

Isomeric SMILES

CC(C)CCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=S)NC3CC3

InChI

InChI=1S/C20H27N5O2S/c1-13(2)10-11-24(20(28)22-15-8-9-15)16-17(21)25(19(27)23-18(16)26)12-14-6-4-3-5-7-14/h3-7,13,15H,8-12,21H2,1-2H3,(H,22,28)(H,23,26,27)