1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-(2-methylprop-2-enyl)-1-propyl-thiourea

Systemtic Name: 1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-(2-methylprop-2-enyl)-1-propyl-thiourea Openeye Name: 1-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-3-(2-methylallyl)-1-propyl-thiourea CAS Name: 1-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-3-(2-methylprop-2-enyl)-1-propylthiourea IUPAC Name: 1-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-3-(2-methylprop-2-enyl)-1-propylthiourea Traditional Name: 1-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-3-(2-methylallyl)-1-propyl-thiourea Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=S)NCC(=C)C

Isomeric SMILES

CCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=S)NCC(=C)C

InChI

InChI=1S/C19H25N5O2S/c1-4-10-23(19(27)21-11-13(2)3)15-16(20)24(18(26)22-17(15)25)12-14-8-6-5-7-9-14/h5-9H,2,4,10-12,20H2,1,3H3,(H,21,27)(H,22,25,26)