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

Systemtic Name: 1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-3-(phenylmethyl)-1-propyl-thiourea Openeye Name: 1-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-3-benzyl-1-propyl-thiourea CAS Name: 1-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-3-(phenylmethyl)-1-propylthiourea IUPAC Name: 1-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-benzyl-1-propylthiourea Traditional Name: 1-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-3-benzyl-1-propyl-thiourea Formula: C19H27N5O2S MolecularWeight: 389.51498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC)C(=S)NCC2=CC=CC=C2)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC)C(=S)NCC2=CC=CC=C2)N

InChI

InChI=1S/C19H27N5O2S/c1-3-5-12-24-16(20)15(17(25)22-18(24)26)23(11-4-2)19(27)21-13-14-9-7-6-8-10-14/h6-10H,3-5,11-13,20H2,1-2H3,(H,21,27)(H,22,25,26)